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Prediction uncertainty in computational chemistry

Pascal Pernot
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hal-04062457 , version 1 (07-04-2023)

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  • HAL Id : hal-04062457 , version 1

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Pascal Pernot. Prediction uncertainty in computational chemistry. Benchmarking of electronic structure methods for non-covalent interactions (CECAM Flagship workshop), Majdi Hochlaf; Ricardo Mata; Daniel Obenchain, Nov 2021, Champs-sur-Marne, France. ⟨hal-04062457⟩
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